Zastosowanie symulacji molekularnych adsorpcji do modelowania przebiegu quasi-równowagowej termodesorpcji węglowodorów z materiałów mikroporowatych.
2018/28/T/ST5/00274
Descriptors
- ST5_6: Materiały porowate
- ST5_19: Metody badań właściwości materiałów
- ST6_12: Obliczenia naukowe, narzędzia modelowania i symulacji
Panel
ST5 – Materials: materials synthesis, structure-properties relations, advanced and functional materials with designed properties, (macro)molecular architecture, material engineering
Host institution
Uniwersytet Jagielloński, Wydział Chemii
Voivodeship: małopolskie
Principal investigator (from the host institution)
Number of co-investigators in the project: 2
Call
ETIUDA 6 – announced on 2017-12-15
- Amount awarded
- 94 548 PLN
- Project start date
- 2018-10-01
- Project end date
- 2019-09-30
- Project duration
- 12 months (the same as in the proposal)
- Project status
- Project settled
Project description
Download the project description in a pdf file
Note — project descriptions were prepared by the authors of the applications themselves and placed in the system in an unchanged form.
Information in the final report
Publication in academic press/journals (5)
-
Adsorption of Alkanes in Zeolites LTA and FAU: Quasi-Equilibrated Thermodesorption Supported by Molecular Simulations
- Authors:
- Sławek, A.; Vicent-Luna, J.M.; Ogorzały, K.; Valencia, S.; Rey, F.; Makowski, W.; Calero, S.
- Academic press:
- Journal of Physical Chemistry C (year: 2019, volume: 123, pages: 29665-29678), Publisher: American Chemical Society
- Status:
- Published
- DOI:
- 10.1021/acs.jpcc.9b07907 – link to the publication
-
Enhancing the Water Capacity in Zr-Based Metal–Organic Framework for Heat Pump and Atmospheric Water Generator Applications
- Authors:
- Luna-Triguero, A.; Sławek, A.; Huinink, H.P.; Vlugt, T.J.H.; Poursaeidesfahani, A.; Vicent-Luna, J.M.; Calero, S.
- Academic press:
- ACS Appied Nano Materials (year: 2019, volume: 2, pages: 3050-3059), Publisher: American Chemical Society
- Status:
- Published
- DOI:
- 10.1021/acsanm.9b00416 – link to the publication
-
Adsorption of n-alkanes in ZIF-8: Influence of crystal size and framework dynamics
- Authors:
- Sławek, A.; Roztocki, K.; Majda, D.; Jaskaniec, S.; Vlugt, T.J.H.; Makowski, W.
- Academic press:
- Microporous and Mesoporous Materials (year: 2021, volume: 312, pages: 110730-), Publisher: Elsevier
- Status:
- Published
- DOI:
- 10.1016/j.micromeso.2020.110730 – link to the publication
-
π-Complexation for olefin/paraffin separation using aluminosilicates
- Authors:
- Luna-Triguero, A.; Sławek, A.; Sánchez-de-Armas. R.; Gutiérrez-Sevillano, J.J; Ania, C.O.; Parra, J.B.; Vicent-Luna, J.M.; Calero, S.
- Academic press:
- Chemical Engineering Journal (year: 2020, volume: 380, pages: 122482), Publisher: Elsevier
- Status:
- Published
- DOI:
- 10.1016/j.cej.2019.122482 – link to the publication
-
Exploiting the π-bonding for the separation of benzene and cyclohexane in zeolites
- Authors:
- González-Galán, C.; Luna-Triguero, A.; Vicent-Luna, J.M.; Zaderenko, A.P.; Sławek, A.; Sánchez-de-Armas, R.; Calero, S.
- Academic press:
- Chemical Engineering Journal (year: 2020, volume: 398, pages: 125678), Publisher: Elsevier
- Status:
- Published
- DOI:
- 10.1016/j.cej.2020.125678 – link to the publication